SCHEMBL28393641

SCHEMBL28393641

CC=CCCOS(=O)(=O)O

nearest known ligand 0.48

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FNTA P49354 2/20 0.34
FNTB P49356 2/20 0.34
CA2 P00918 1/20 0.31
CA9 Q16790 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL21201763 1.00 FNTA (0.34) FNTAFNTBCA2CA9
SCHEMBL17469879 0.85 CA2 (0.36) FNTAFNTBCA2CA9
SCHEMBL5081911 0.84 CA2 (0.30) CA2CA9
SCHEMBL6104909 0.81
SCHEMBL10766980 0.79 USP2 (0.50) CA2CA9
SCHEMBL27942471 0.79 USP2 (0.50) CA2CA9
SCHEMBL17469884 0.77 CA2 (0.31) FNTAFNTBCA2CA9
SCHEMBL17911702 0.77 LPAR3 (0.44) CA2
SCHEMBL17911705 0.77 LPAR3 (0.44) CA2
SCHEMBL17911701 0.77 LPAR3 (0.44) CA2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111066192-A Nonaqueous electrolyte secondary battery 三菱化学株式会社 2020-04-24 CN disclosed